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TM 5275 sodium salt - ≥98%(HPLC), high purity , CAS No.1103926-82-4

COA

Grade & Purity:

≥98%(HPLC)

Cas Number: 1103926-82-4
Molecular Weight: 543.97
PubChem CID: 53240409
PubChem SID: 504771112

In stock

Item Number

T287019

Grouped product items
SKU	Size	Availability	Price
T287019-5mg	5mg	2	$296.90
T287019-10mg	10mg	3	$420.90
T287019-25mg	25mg	2	$718.90
T287019-50mg	50mg	2	$1,214.90
T287019-100mg	100mg	2	$2,207.90
T287019-200mg	200mg	2	$3,974.90

Plasminogen activator inhibitor-1 (PAI-1) inhibitor

View related series

Amino Acid/Protein Metabolism (1836) Metabolic Enzyme/Protease (4860) PAI-1 (26)

Basic Description

Synonyms	5-Chloro-2-[[2-[2-[4-(Diphenylmethyl)-1-piperazinyl]-2-oxoethoxy]acetyl]amino]benzoic acid sodium salt \| 2-[2-[2-(4-Benzhydrylpiperazin-1-yl)-2-oxoethoxy]acetamido]-5-chlorobenzoic acid sodium salt, 5-Chloro--[[2-[2-[4-(diphenylmethyl)-1-piperazinyl]-2-ox
Specifications & Purity	≥98%(HPLC)
Biochemical and Physiological Mechanisms	Plasminogen activator inhibitor-1 (PAI-1) inhibitor. Orally bioavailable.TMS5275 is an orally available, potent and selective inhibitor of PAI-1 that delivers antithrombotic benefits devoid of bleeding effect in nonhuman primates.
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Diphenylmethanes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Diphenylmethanes
Intermediate Tree Nodes	Not available
Direct Parent	Diphenylmethanes
Alternative Parents	Acylaminobenzoic acid and derivatives Halobenzoic acids 3-halobenzoic acids Anilides Benzoic acids Benzoyl derivatives N-arylamides Aralkylamines N-alkylpiperazines Chlorobenzenes Aryl chlorides Vinylogous amides Tertiary carboxylic acid amides Secondary carboxylic acid amides Amino acids Carboxylic acid salts Trialkylamines Organic metal halides Azacyclic compounds Dialkyl ethers Carboxylic acids Hydrocarbon derivatives Organochlorides Organic zwitterions Organic sodium salts Organic oxides Carbonyl compounds
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Acylaminobenzoic acid or derivatives - Diphenylmethane - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3-halobenzoic acid - Halobenzoic acid - Benzoic acid or derivatives - Anilide - Benzoic acid - Benzoyl - N-arylamide - Halobenzene - Aralkylamine - Chlorobenzene - N-alkylpiperazine - Piperazine - Aryl chloride - Aryl halide - 1,4-diazinane - Tertiary carboxylic acid amide - Vinylogous amide - Carboxamide group - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid salt - Tertiary amine - Amino acid - Organic metal halide - Azacycle - Organic alkali metal salt - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Dialkyl ether - Ether - Organic oxide - Amine - Organic sodium salt - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organic nitrogen compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504771112
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504771112
IUPAC Name	sodium;2-[[2-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethoxy]acetyl]amino]-5-chlorobenzoate
INCHI	InChI=1S/C28H28ClN3O5.Na/c29-22-11-12-24(23(17-22)28(35)36)30-25(33)18-37-19-26(34)31-13-15-32(16-14-31)27(20-7-3-1-4-8-20)21-9-5-2-6-10-21;/h1-12,17,27H,13-16,18-19H2,(H,30,33)(H,35,36);/q;+1/p-1
InChIKey	JSHSGBIWNPQCQZ-UHFFFAOYSA-M
Smiles	C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)COCC(=O)NC4=C(C=C(C=C4)Cl)C(=O)[O-].[Na+]
Isomeric SMILES	C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)COCC(=O)NC4=C(C=C(C=C4)Cl)C(=O)[O-].[Na+]
PubChem CID	53240409
Molecular Weight	543.97

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

8 results found

Lot Number	Certificate Type	Date	Item
D2307038	Certificate of Analysis	Mar 10, 2023	T287019
D2317102	Certificate of Analysis	Mar 10, 2023	T287019
D2317087	Certificate of Analysis	Mar 10, 2023	T287019
D2317092	Certificate of Analysis	Mar 10, 2023	T287019
D2317039	Certificate of Analysis	Mar 10, 2023	T287019
D2317082	Certificate of Analysis	Mar 10, 2023	T287019
D2317041	Certificate of Analysis	Mar 10, 2023	T287019
D2317093	Certificate of Analysis	Mar 10, 2023	T287019

Chemical and Physical Properties

Solubility	Solvent:DMSO, Max Conc. mg/mL: 54.4, Max Conc. mM: 100
Sensitivity	Moisture sensitive
Molecular Weight	544.000 g/mol
XLogP3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	9
Exact Mass	543.154 Da
Monoisotopic Mass	543.154 Da
Topological Polar Surface Area	102.000 Å²
Heavy Atom Count	38
Formal Charge	0
Complexity	752.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	2

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